ethane; methanamide; (4-methoxy-3-nitro-phenyl)methyl-dimethyl-azanium; chloride

Systemtic Name: ethane; methanamide; (4-methoxy-3-nitro-phenyl)methyl-dimethyl-azanium; chloride Openeye Name: ethane; formamide; (4-methoxy-3-nitro-phenyl)methyl-dimethyl-ammonium; chloride CAS Name: ethane; formamide; (4-methoxy-3-nitrophenyl)methyl-dimethylammonium; chloride IUPAC Name: ethane; formamide; (4-methoxy-3-nitrophenyl)methyl-dimethylazanium; chloride Traditional Name: ethane; formamide; (4-methoxy-3-nitro-benzyl)-dimethyl-ammonium; chloride Formula: C13H24ClN3O4 MolecularWeight: 321.80036

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Descriptors Computed from Structure

Canonical SMILES:

CC.C[NH+](C)CC1=CC(=C(C=C1)OC)[N+](=O)[O-].C(=O)N.[Cl-]

Isomeric SMILES

CC.C[NH+](C)CC1=CC(=C(C=C1)OC)[N+](=O)[O-].C(=O)N.[Cl-]

InChI

InChI=1S/C10H14N2O3.C2H6.CH3NO.ClH/c1-11(2)7-8-4-5-10(15-3)9(6-8)12(13)14;1-2;2-1-3;/h4-6H,7H2,1-3H3;1-2H3;1H,(H2,2,3);1H